SCHEMBL12972444

SCHEMBL12972444

CCCCC[C@H](NC(=O)[C@H](CCCCNC(=O)CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCCC[C@H](NC)C(N)=O)NC)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.57
▸ TLR2 O60603 1/20 0.44
▸ CCKAR P32238 6/20 0.39
▸ CCKBR P32239 6/20 0.39
▸ ALB P02768 1/20 0.39
▸ SIRT5 Q9NXA8 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8114033 0.96 GLP1R (0.52) GLP1RTLR2CCKARCCKBRALB
SCHEMBL8106168 0.92 GLP1R (0.48) GLP1RTLR2CCKARCCKBRALB
SCHEMBL12972441 0.91 GLP1R (0.68) GLP1RTLR2CCKARCCKBRNOD1
SCHEMBL8115663 0.90 GLP1R (0.51) GLP1RCCKARCCKBRALBSIRT5
SCHEMBL14438806 0.89 GLP1R (0.70) GLP1RTLR2CCKARCCKBRNOD1
SCHEMBL15259287 0.89 GLP1R (0.70) GLP1RTLR2CCKARCCKBRNOD1
SCHEMBL12972439 0.87 GLP1R (0.61) GLP1RTLR2CCKARCCKBRSIRT6
SCHEMBL14550380 0.87 GLP1R (0.58) GLP1RTLR2CCKARCCKBRSIRT5
SCHEMBL14685801 0.85 GLP1R (0.48) GLP1RTLR2CCKARCCKBRALB
SCHEMBL13577576 0.85 GLP1R (0.76) GLP1RCCKARCCKBRNOD1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8632753-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO SUISSE SA (CH) 2014-01-21 — — US disclosed
US-7854919-B2 Multivalent constructs for therapeutic and diagnostic applications Bracco, Suisse SA (CH) 2010-12-21 — — US disclosed
US-20070243139-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS BRACCO INTERNATIONAL B.V. (NL) 2007-10-18 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070243139-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 GLP1R 2595/4885TLR2 3487/4885CCKAR 4404/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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